Geometry & MOs

Info

ID:	425701
PubChem CID:	135127479
Reduced:	FSC7H11 (1)
Stoich.:	ABC7D11 (1)
Weight, g/mol:	232.1075
ΔH_f, kcal/mol:	-37.92
Dipole, Da:	3.97
IP(EA), eV:	-8.7(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropoxy)-3-(2,2,2-trifluoroethyl)benzene

Drug info:

PubChemData

Smile

CC(C)/C(=C/C(=S)C)/F

DOS

IR

Vibrations